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methyl 1-benzofuran-4-carboxylate

methyl 1-benzofuran-4-carboxylate

CAS: 41019-56-1

Formula: C10H8O3

SMILES: COC(=O)C1=C2C=COC2=CC=C1

IUPAC: methyl 1-benzofuran-4-carboxylate

InChI: InChI=1S/C10H8O3/c1-12-10(11)8-3-2-4-9-7(8)5-6-13-9/h2-6H,1H3

Composition: C (68.18%), H (4.58%), O (27.24%)

Molar Mass: 176.171

Atom Count: 21

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 176.047344118
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey QUPMFELCGIVSMG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.92
Topological Polar Surface Area 39.44
Polarizability 19.13
Ring Count 2
Rotatable Bond Count 2

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95% <5 Days 41019-56-1 $7,000.00$7,000.00
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